2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride

C12H17Cl3N2O — CID 119319553

IUPAC2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride
SMILESCC(C)(CNC(=O)CN)c1c(Cl)cccc1Cl.Cl
InChIInChI=1S/C12H16Cl2N2O.ClH/c1-12(2,7-16-10(17)6-15)11-8(13)4-3-5-9(11)14;/h3-5H,6-7,15H2,1-2H3,(H,16,17);1H
InChIKeyVFJSHPIHPOUUTC-UHFFFAOYSA-N
MW311.64 g/mol
LogP2.77
Rot. Bonds4

About 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride

2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride (PubChem CID 119319553) has the molecular formula C12H17Cl3N2O and a molecular weight of 311.64 g/mol. Its IUPAC name is 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride
PubChem CID119319553
Molecular FormulaC12H17Cl3N2O
Molecular Weight311.64 g/mol
Exact Mass310.04
IUPAC Name2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride
SMILESCC(C)(CNC(=O)CN)c1c(Cl)cccc1Cl.Cl
InChIInChI=1S/C12H16Cl2N2O.ClH/c1-12(2,7-16-10(17)6-15)11-8(13)4-3-5-9(11)14;/h3-5H,6-7,15H2,1-2H3,(H,16,17);1H
InChIKeyVFJSHPIHPOUUTC-UHFFFAOYSA-N
XLogP2.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.64
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide
CID 119319554
4-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]pentanamide
CID 120562379
4-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]-3-methoxybutanamide
CID 120591825
3-amino-N-[2-(2-chloro-6-fluorophenyl)-2-methylpropyl]butanamide
CID 119777725
N-[2-(2,6-dichlorophenyl)-2-methylpropyl]piperidine-4-carboxamide;hydrochloride
CID 75429785
4-[[2-(2,6-dichlorophenyl)-2-methylpropyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120673517
2-amino-N-[2-methyl-2-(1H-pyrrol-2-yl)propyl]acetamide
CID 115151835
N-tert-butyl-2-(2,6-dichlorophenyl)-2-methylpropan-1-amine
CID 55195552
2-amino-N-[3-(3-chlorophenyl)-2,2-dimethylpropyl]acetamide
CID 119339868
2-amino-N-(2,2-dimethyl-3-phenylpropyl)acetamide
CID 119329644
2-amino-N-[2-(2,6-dichlorophenyl)propyl]acetamide
CID 119315000
2-amino-N-[2-(2-chloro-6-fluorophenyl)-2-methylpropyl]-3-methoxypropanamide
CID 120991102

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride (CID 119319553) is 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride is CC(C)(CNC(=O)CN)c1c(Cl)cccc1Cl.Cl.
What is the InChIKey of 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride?
The InChIKey is VFJSHPIHPOUUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O.ClH/c1-12(2,7-16-10(17)6-15)11-8(13)4-3-5-9(11)14;/h3-5H,6-7,15H2,1-2H3,(H,16,17);1H.
What are the key properties of 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride?
2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride has a molecular weight of 311.64 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2,6-dichlorophenyl)-2-methylpropyl]acetamide;hydrochloride is sourced from PubChem (CID 119319553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).